Charge: 2
Inchi:1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/q+2
Electronic States
Energy
(eV)
-691.62195
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.04269 b
(cm-1)
0.00858 c
(cm-1)
0.00715
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.01400
Diff mu Y
(Debye)
0.11000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00035
-0.00021
0.00000
2
-0.00066
0.00032
0.00000
3
0.01547
0.01046
0.00000
4
0.00269
-0.00148
0.00000
5
-0.00024
-0.00079
0.00000
6
-0.00022
-0.00026
0.00000
7
0.00199
-0.00133
0.00000
8
0.01277
0.00809
0.00000
9
-0.00641
0.04039
0.00000
10
-0.00919
0.00154
0.00000
11
0.01459
-0.00250
0.00000
12
0.01013
-0.06348
0.00000
13
-0.02020
-0.01278
0.00000
14
-0.00346
0.00220
0.00000
15
0.00030
0.00041
0.00000
16
0.00027
0.00107
0.00000
17
-0.00166
0.00088
0.00000
18
-0.01001
-0.00674
0.00000
19
-0.02894
0.01235
0.00000
20
0.08909
-0.03077
0.00000
21
0.06993
-0.44831
0.00000
22
-0.12711
-0.09856
0.00000
23
-0.01900
0.00672
0.00000
24
0.11257
0.07845
0.00000
25
-0.17423
-0.12150
0.00000
26
0.03381
-0.01188
0.00000
27
0.20094
0.15584
0.00000
28
-0.10991
0.70481
0.00000
29
-0.14170
0.04906
0.00000
30
0.01738
-0.00772
0.00000